![3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.2]-OCT-5-ENE](/api/spectrum/ATcPvbCoOmn/structure.png?h=300&w=458 "3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.2]-OCT-5-ENE")
| SpectraBase Compound ID | 2j3a1WC2YzV |
|---|---|
| InChI | InChI=1S/C8H9F3S/c9-8(10,11)7-5-1-3-6(12-7)4-2-5/h1,3,5-7H,2,4H2/t5-,6+,7+/m0/s1 |
| InChIKey | YJMLUKPNWLVXFH-RRKCRQDMSA-N |
| Mol Weight | 194.22 g/mol |
| Molecular Formula | C8H9F3S |
| Exact Mass | 194.037706 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATcPvbCoOmn |
|---|---|
| Name | 3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.2]-OCT-5-ENE |
| CAS Registry Number | 122491-45-6 |
| Compound Number | 15C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C8H9F3S |
| InChI | InChI=1S/C8H9F3S/c9-8(10,11)7-5-1-3-6(12-7)4-2-5/h1,3,5-7H,2,4H2/t5-,6+,7+/m0/s1 |
| InChIKey | YJMLUKPNWLVXFH-RRKCRQDMSA-N |
| Literature Reference Author | B.SCHULER,W.SUNDERMEYER |
| Literature Reference Citation | CHEM.BER.,123,177(1990) |
| Literature Reference DOI | 10.1002/cber.19901230130 |
| Solvent | CDCl3 |
| Source File Reference | UWED12269 |